3O4M
Crystal structure of porcine pancreatic phospholipase A2 in complex with 1,2-dihydroxybenzene
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-04-02 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.542 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 69.240, 69.240, 69.670 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.990 - 2.500 |
| R-factor | 0.18355 |
| Rwork | 0.182 |
| R-free | 0.22257 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.803 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | Auto (MR) |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.960 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.092 | 0.092 |
| Number of reflections | 6617 | |
| Completeness [%] | 95.1 | 95.07 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 294 | 5% MPD, 0.05M Tris Maleate, 5mM Calcium Chloride, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 294.0K |
